SCHEMBL5956763

SCHEMBL5956763

COC(=O)c1ccc2c(c1C)SCCC2NC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
EED O75530 1/20 0.35
RBBP4 Q09028 1/20 0.35
SUZ12 Q15022 1/20 0.35
EZH2 Q15910 1/20 0.35
AEBP2 Q6ZN18 1/20 0.35
GAA P10253 1/20 0.35
PTGER4 P35408 1/20 0.34
ATR Q13535 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
KDM1A O60341 1/20 0.33
MAOB P27338 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NPC1 O15118 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5956756 1.00 MEN1 (0.40) MEN1KMT2AEEDRBBP4SUZ12
SCHEMBL5956517 0.90 GAA (0.36) MEN1KMT2AGAANFKB1NFKB2
SCHEMBL5956523 0.90 GAA (0.36) MEN1KMT2AGAANFKB1NFKB2
SCHEMBL5956593 0.82 TYK2 (0.37) L3MBTL1
SCHEMBL5956534 0.82 TYK2 (0.37) L3MBTL1
SCHEMBL8179948 0.81 GAA (0.37) EEDRBBP4SUZ12EZH2AEBP2
SCHEMBL5956529 0.79 KMT2A (0.43) MEN1KMT2AEEDRBBP4SUZ12
SCHEMBL5956545 0.79 KMT2A (0.43) MEN1KMT2AEEDRBBP4SUZ12
SCHEMBL5956853 0.78 KMT2A (0.40) MEN1KMT2AGAANFKB1NFKB2
SCHEMBL5956511 0.78 KMT2A (0.40) MEN1KMT2AGAANFKB1NFKB2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1270570-B1 AMIDE COMPOUNDS AND USE THEREOF MITSUBISHI PHARMA CORP (JP) 2006-05-31 EP disclosed
US-6933305-B2 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2005-08-23 US disclosed
US-20030158413-A1 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2003-08-21 US disclosed
EP-1270570-A1 AMIDE COMPOUNDS AND USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-01-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030158413-A1 Amide compounds and use thereof ROCK2, ROCK1, RHOT2 MEN1 2543/4885KMT2A 1253/4885EED 3902/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.